N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C18H18ClN3O3S3 MolecularWeight: 456.00182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C18H18ClN3O3S3/c1-11-9-13(19)10-14-16(11)20-18(27-14)21-17(23)12-4-6-22(7-5-12)28(24,25)15-3-2-8-26-15/h2-3,8-10,12H,4-7H2,1H3,(H,20,21,23)